dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium

C20H51N2O4Si4+ — CID 167366189

IUPACdimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium
SMILESC[NH+](C)CCCCCC(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C20H50N2O4Si4/c1-22(2)18-14-12-13-16-20(23)21-17-15-19-30(24-27(3,4)5,25-28(6,7)8)26-29(9,10)11/h12-19H2,1-11H3,(H,21,23)/p+1
InChIKeyZNUWJYLGWYZBOE-UHFFFAOYSA-O
MW495.98 g/mol
LogP3.69
Rot. Bonds16

About dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium

dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium (PubChem CID 167366189) has the molecular formula C20H51N2O4Si4+ and a molecular weight of 495.98 g/mol. Its IUPAC name is dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium.

Molecular Properties

Compound Namedimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium
PubChem CID167366189
Molecular FormulaC20H51N2O4Si4+
Molecular Weight495.98 g/mol
Exact Mass495.29
IUPAC Namedimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium
SMILESC[NH+](C)CCCCCC(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C20H50N2O4Si4/c1-22(2)18-14-12-13-16-20(23)21-17-15-19-30(24-27(3,4)5,25-28(6,7)8)26-29(9,10)11/h12-19H2,1-11H3,(H,21,23)/p+1
InChIKeyZNUWJYLGWYZBOE-UHFFFAOYSA-O
XLogP3.69
TPSA61.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500495.98
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

[6-[3-[bis[[ethyl(oxo)silyl]methyl]-trimethylsilyloxysilyl]propylamino]-6-oxohexyl]-dimethylazanium;molecular hydrogen;chloride
CID 167672800
N-(3-trimethoxysilylpropyl)tricosanamide
CID 175992989
N-(3-trimethoxysilylpropyl)octanamide
CID 71362207
ethyl 3-(dimethylamino)-8-oxo-8-[3-tris(trimethylsilyloxy)silylpropylamino]octanoate
CID 174057343
dimethyl-[3-[3-(3-triethoxysilylpropylsulfanyl)propanoylamino]propyl]azanium
CID 143434250
N-(3-triethoxysilylpropyl)hexanamide
CID 71321496
4-[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]propylamino]-4-oxobutanoic acid
CID 59172342
methyl 6-[[6-[[6-[[6-[(6-methoxy-6-oxohexyl)amino]-6-oxohexyl]amino]-6-oxohexyl]amino]-6-oxohexyl]amino]-6-oxohexanoate
CID 71625530
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
N-hexadecylhexanamide
CID 4953738
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069

Frequently Asked Questions

What is the IUPAC name of dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium?
The IUPAC name of dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium (CID 167366189) is dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium.
What is the SMILES notation for dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium?
The canonical SMILES for dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium is C[NH+](C)CCCCCC(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium?
The InChIKey is ZNUWJYLGWYZBOE-UHFFFAOYSA-O. The full InChI is InChI=1S/C20H50N2O4Si4/c1-22(2)18-14-12-13-16-20(23)21-17-15-19-30(24-27(3,4)5,25-28(6,7)8)26-29(9,10)11/h12-19H2,1-11H3,(H,21,23)/p+1.
What are the key properties of dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium?
dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium has a molecular weight of 495.98 g/mol, XLogP of 3.69, 16 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[6-oxo-6-[3-tris(trimethylsilyloxy)silylpropylamino]hexyl]azanium is sourced from PubChem (CID 167366189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).